4-chloro-N-(pyrimidin-2-yl)butanamide

Base Information

• Chemical Name: 4-chloro-N-(pyrimidin-2-yl)butanamide
• CAS No.: 27179-31-3
• Molecular Formula: C8H10 Cl N3 O
• Molecular Weight: 199.64
• Hs Code.: 2933599090
• DSSTox Substance ID: DTXSID50377198
• Wikidata: Q82166318
• Mol file: 27179-31-3.mol

Synonyms:27179-31-3;4-chloro-N-(pyrimidin-2-yl)butanamide;4-chloro-N-(2-pyrimidinyl)butanamide;4-chloro-N-pyrimidin-2-ylbutanamide;DTXSID50377198;CBA17931;AKOS000193527;SB55880;CS-0323821;FT-0680362;4J-024;A877007;J-515167

Chemical Property of 4-chloro-N-(pyrimidin-2-yl)butanamide

Chemical Property:

• Melting Point: 100-103°C
• Boiling Point: °Cat760mmHg
• PKA: 12.10±0.70(Predicted)
• Flash Point: °C
• PSA: 54.88000
• Density: 1.301g/cm³
• LogP: 1.50710
• XLogP3: 0.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 199.0512396
• Heavy Atom Count: 13
• Complexity: 160

Purity/Quality:

97% ^*data from raw suppliers

4-Chloro-N-(2-pyrimidinyl)butanamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CN=C(N=C1)NC(=O)CCCCl